5-[2-bromanyl-4-(trifluoromethyl)phenoxy]-N-(2-hydroxyethyl)-2-nitro-benzamide

Systemtic Name: 5-[2-bromanyl-4-(trifluoromethyl)phenoxy]-N-(2-hydroxyethyl)-2-nitro-benzamide Openeye Name: 5-[2-bromo-4-(trifluoromethyl)phenoxy]-N-(2-hydroxyethyl)-2-nitro-benzamide CAS Name: 5-[2-bromo-4-(trifluoromethyl)phenoxy]-N-(2-hydroxyethyl)-2-nitrobenzamide IUPAC Name: 5-[2-bromo-4-(trifluoromethyl)phenoxy]-N-(2-hydroxyethyl)-2-nitrobenzamide Traditional Name: 5-[2-bromo-4-(trifluoromethyl)phenoxy]-N-(2-hydroxyethyl)-2-nitro-benzamide Formula: C16H12BrF3N2O5 MolecularWeight: 449.17609

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)Br)OC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)NCCO

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)Br)OC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)NCCO

InChI

InChI=1S/C16H12BrF3N2O5/c17-12-7-9(16(18,19)20)1-4-14(12)27-10-2-3-13(22(25)26)11(8-10)15(24)21-5-6-23/h1-4,7-8,23H,5-6H2,(H,21,24)